Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3592672 | 0.89 | CREBBP (0.53) | NOS1CREBBPOPRK1KDM4EALDH1A1 | |
| SCHEMBL3592677 | 0.89 | CREBBP (0.53) | NOS1CREBBPOPRK1KDM4EALDH1A1 | |
| SCHEMBL18324458 | 0.83 | SLC7A5 (0.50) | NOS1CREBBPOPRK1KDM4EALDH1A1 | |
| SCHEMBL11601369 | 0.79 | ALDH1A1 (0.46) | NOS1CREBBPOPRK1ALDH1A1TSHR | |
| SCHEMBL22057895 | 0.78 | PDE3B (0.51) | NOS1CREBBPKDM4EALDH1A1IL4I1 | |
| SCHEMBL4143480 | 0.76 | NOS1 (0.50) | NOS1CREBBPOPRK1KDM4EALDH1A1 | |
| SCHEMBL4586630 | 0.76 | MEN1 (0.47) | OPRK1OPRD1KMT2AMEN1SMYD3 | |
| SCHEMBL21163220 | 0.76 | NOS1 (0.56) | NOS1CREBBPOPRK1KDM4EALDH1A1 | |
| SCHEMBL4593675 | 0.75 | CYP3A4 (0.47) | OPRK1KDM4EALDH1A1OPRD1SMYD3 | |
| SCHEMBL7960935 | 0.75 | SLC7A5 (0.48) | ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6268378-B1 | TREATING AND PREVENTING OSTEOPOROSIS, AND INHIBITING VASCULAR RESTENOSIS, DIABETIC RETINOPATHY, MACULAR DEGENERATION, ANGIOGENESIS, ATHEROSCLEROSIS, INFLAMMATION, VIRAL DISEASE, AND TUMOR GROWTH. | MERCK & CO., INC. | 2001-07-31 | — | — | US | disclosed |
| US-6066648-A | USEFUL IN INHIBITING BONE RESORPTION, TREATING AND PREVENTING OSTEOPOROSIS, AND INHIBITING VASCULAR RESTENOSIS, DIABETIC RETINOPATHY, MACULAR DEGENERATION, ANGIOGENESIS, ATHEROSCLEROSIS, INFLAMMATION, VIRAL DISEASE, AND TUMOR GROWTH | MERCK & CO., INC. (US) | 2000-05-23 | — | — | US | disclosed |